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α,α,α-Trifluorotoluene solution

Name: α,α,α-Trifluorotoluene solution
Brand: ALDRICH
Price: 195 USD

suitable for NMR (reference standard), 0.05% in benzene-d₆ (99.6 atom % D)

Synonym(s):

Benzotrifluoride

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Pack Size	SKU	Availability	Price
1 pkg		Check Cart for Availability	$195.00
1 pkg		Check Cart for Availability	$200.00

About This Item

Linear Formula:

C₆H₅CF₃

CAS Number:

98-08-8

Molecular Weight:

146.11

NACRES:

NA.12

PubChem Substance ID:

24879222

UNSPSC Code:

12142201

EC Number:

214-061-8

MDL number:

MFCD00000372

Assay:

99% (CP)

$195.00

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Properties

assay

99% (CP)

Quality Level

200

concentration

0.05% in benzene-d₆ (99.6 atom % D)

technique(s)

NMR: suitable

NMR tube size

5 mm × 7 in. , 5 mm × 8 in.

suitability

suitable for NMR (reference standard)

SMILES string

FC(F)(F)c1ccccc1

InChI

1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H

InChI key

GETTZEONDQJALK-UHFFFAOYSA-N

Description

Features and Benefits

¹⁹F sensitivity

Preparation Note

5 mm O.D. tube contains 0.700 mL.

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1 of 1

This Item	T63703	612685	733806
Sigma-Aldrich 551406 α,α,α-Trifluorotoluene solution	Sigma-Aldrich T63703 α,α,α-Trifluorotoluene	Sigma-Aldrich 612685 α,α,α-Trifluorotoluene solution	Sigma-Aldrich 733806 α,α,α-Trifluorotoluene solution
assay 99% (CP)	assay ≥99%	assay -	assay -
technique(s) NMR: suitable	technique(s) -	technique(s) NMR: suitable	technique(s) NMR: suitable
Quality Level 200	Quality Level 200	Quality Level 200	Quality Level -
concentration 0.05% in benzene-d₆ (99.6 atom % D)	concentration -	concentration 0.05% in benzene-d₆ (99.6 atom % D)	concentration 0.05% in benzene-d₆ (99.6 atom % D)
suitability suitable for NMR (reference standard)	suitability -	suitability suitable for NMR (reference standard)	suitability suitable for NMR (reference standard)
NMR tube size 5 mm × 7 in. , 5 mm × 8 in.	NMR tube size -	NMR tube size 3 mm × 8 in.	NMR tube size 10 mm × 8 in.

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pictograms

GHS02,GHS08,GHS07

signalword

Danger

hcodes

H225,H304,H315,H319,H340,H350,H372,H412

pcodes

P210 - P273 - P301 + P310 - P303 + P361 + P353 - P305 + P351 + P338 - P331

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Carc. 1A - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 1B - Skin Irrit. 2 - STOT RE 1

target_organs

Blood

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

12.0 °F - closed cup

flash_point_c

-11.11 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Articles

NMR Reference Standards

NMR reference standards ensure proper instrument performance. Review key operational parameters for these standards such as pw90, sensitivity, resolution and line shape.

Validation of parachlorobenzotrifluoride, benzotrifluoride, and monochlorotoluene on diffusive samplers.

C Yost et al.

Applied occupational and environmental hygiene, 15(1), 165-170 (2000-03-11)

Three solvents (OXSOL 10, monochlorotoluene or mixed isomers of 1- chloro-2-methyl benzene and 1-chloro-4-methyl benzene; OXSOL 100, parachlorobenzotrifluoride or 1-chloro-4-(trifluoromethyl) benzene; and OXSOL 2000, benzotrifluoride or trifluoromethyl benzene) produced by Occidental Chemical Corporation (Niagara Falls, NY) were considered as candidates

Force field calculations for 2-amino-5-chloro- and 2-amino-5-bromo-benzotrifluorides.

R A Yadav et al.

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 64(2), 454-463 (2006-01-18)

Force field calculations have been carried out for 2-amino-5-chloro- and 2-amino-5-bromo-benzotrifluorides using the earlier (Ref. of this article) reported IR and Raman spectra. As the frequencies of the corresponding modes for the C-Br and the C-Cl groups do not differ

Oxidative trifluoromethylation of arylboronates with shelf-stable potassium (trifluoromethyl)trimethoxyborate.

Bilal A Khan et al.

Chemistry (Weinheim an der Bergstrasse, Germany), 18(6), 1577-1581 (2012-01-13)

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Global Trade Item Number

SKU	GTIN
551406-8IN	04061838205018
551406-7IN	04061838111401

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